SCHEMBL1283602

SCHEMBL1283602

O=C(CBr)c1ccc(Oc2ccc(Cl)cc2)cc1

nearest known ligand 0.78

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 9/20 0.78
MMP1 P03956 2/20 0.59
PTPN1 P18031 5/20 0.52
CYP3A4 P08684 1/20 0.47
MAPK14 Q16539 1/20 0.47
ERCC5 P28715 1/20 0.46
FEN1 P39748 1/20 0.46
HPGD P15428 1/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL204218 0.90 GSK3B (0.70) GSK3BMMP1PTPN1ERCC5FEN1
SCHEMBL118608 0.88 GSK3B (1.00) GSK3BPTPN1ERCC5FEN1
SCHEMBL15756687 0.83 GSK3B (0.77) GSK3BMMP1CYP3A4MAPK14ERCC5
SCHEMBL11110229 0.83 MMP1 (0.61) GSK3BMMP1CYP3A4MAPK14ERCC5
SCHEMBL8260473 0.83 GSK3B (0.77) GSK3BMMP1PTPN1ERCC5FEN1
SCHEMBL1350830 0.83 GSK3B (0.67) GSK3BMMP1PTPN1ERCC5FEN1
SCHEMBL5165015 0.82 GSK3B (0.88) GSK3BPTPN1ERCC5FEN1
SCHEMBL7500366 0.82 NR4A2 (0.69) GSK3BPTPN1
SCHEMBL6142809 0.81 MMP1 (0.59) GSK3BMMP1CYP3A4MAPK14HPGD
SCHEMBL3366230 0.81 PTPN1 (0.78) GSK3BPTPN1CYP3A4MAPK14ERCC5

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107625766-B Application of thiazole compound as antibacterial synergist 上海医药工业研究院 2021-08-31 CN disclosed
US-20120088778-A1 AZOLE DERIVATIVES AND FUSED BICYCLIC AZOLE DERIVATIVES AS THERAPEUTIC AGENTS TRANSTECH PHARMA, INC. (US) 2012-04-12 US disclosed
EP-1482931-B1 MONO- AND BICYCLIC AZOLE DERIVATIVES THAT INHIBIT THE INTERACTION OF LIGANDS WITH RAGE TRANSTECH PHARMA INC (US) 2011-10-19 EP disclosed
US-20100256119-A1 Azole derivatives and fused bicyclic azole derivatives as therapeutic agents TRANSTECH PHARMA, INC. 2010-10-07 US disclosed
US-7737285-B2 Azole derivatives and fused bicyclic azole derivatives as therapeutic agents TRANSTECH PHARMA, INC. (US) 2010-06-15 US disclosed
US-7714013-B2 Azole derivatives and fused bicyclic azole derivatives as therapeutic agents TRANSTECH PHARMA, INC. (US) 2010-05-11 US disclosed
US-7361678-B2 Azole derivatives and fused bicyclic azole derivatives as therapeutic agents TRANSTECH PHARMA, INC. (US) 2008-04-22 US disclosed
US-20070213347-A1 Azole derivatives and fused bicyclic azole derivatives as therapeutic agents TRANSTECH PHARMA (US) 2007-09-13 US disclosed
US-20070021386-A1 Azole derivatives and fused bicyclic azole derivatives as therapeutic agents TRANSTECH PHARMA (US) 2007-01-25 US disclosed
EP-1482931-A2 MONO- AND BICYCLIC AZOLE DERIVATIVES THAT INHIBIT THE INTERACTION OF LIGANDS WITH RAGE Transtech Pharma, Inc. (US) 2004-12-08 EP disclosed
US-20040082542-A1 Azole derivatives and fused bicyclic azole derivatives as therapeutic agents VTV THERAPEUTICS LLC 2004-04-29 US disclosed
WO-2003075921-A2 MONO- AND BICYCLIC AZOLE DERIVATIVES THAT INHIBIT THE INTERACTION OF LIGANDS WITH RAGE TRANSTECH PHARMA, INC. (US) 2003-09-18 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100256119-A1 Azole derivatives and fused bicyclic azole derivatives as therapeutic agents AGER, S100A4, S100B GSK3B 1743/4885MMP1 749/4885PTPN1 2702/4885
US-20040082542-A1 Azole derivatives and fused bicyclic azole derivatives as therapeutic agents AGER, S100A4, S100B GSK3B 2566/4885MMP1 685/4885PTPN1 2864/4885
US-20070021386-A1 Azole derivatives and fused bicyclic azole derivatives as therapeutic agents AGER, S100A4, S100B GSK3B 1879/4885MMP1 650/4885PTPN1 2907/4885
US-20120088778-A1 AZOLE DERIVATIVES AND FUSED BICYCLIC AZOLE DERIVATIVES AS THERAPEUTIC AGENTS AGER, S100A4, S100B GSK3B 1879/4885MMP1 650/4885PTPN1 2907/4885
US-20070213347-A1 Azole derivatives and fused bicyclic azole derivatives as therapeutic agents AGER, S100A4, S100B GSK3B 1879/4885MMP1 650/4885PTPN1 2907/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.